≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | CC=CC(C)O |
|---|---|
| IUPAC Name | (E)-pent-3-en-2-ol |
| InChIKey | GJYMQFMQRRNLCY-ONEGZZNKSA-N |
| INCHI | 1S/C5H10O/c1-3-4-5(2)6/h3-6H,1-2H3/b4-3+ |
| Isomeric SMILES | C/C=C/C(C)O |
| WGK Germany | 3 |
| PubChem CID | 5366239 |
| Molecular Weight | 86.13 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Alcohols and polyols |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Secondary alcohols |
| Alternative Parents | Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Secondary alcohol - Hydrocarbon derivative - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). |
| External Descriptors | Not available |
| Flash Point(°F) | 96.8 °F |
|---|---|
| Flash Point(°C) | 36 °C |
| Boil Point(°C) | 119-121° C (lit.) |
| Molecular Weight | 86.130 g/mol |
| XLogP3 | 0.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 86.0732 Da |
| Monoisotopic Mass | 86.0732 Da |
| Topological Polar Surface Area | 20.200 Ų |
| Heavy Atom Count | 6 |
| Formal Charge | 0 |
| Complexity | 47.900 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 1 |
| Covalently-Bonded Unit Count | 1 |
| 1. Yuyan Wei, Ling Xie, Bertrand Muhoza, Qian Liu, Shiqing Song. (2024) Generation of Olfactory Compounds in Cat Food Attractants: Chicken Liver-Derived Protein Hydrolysates and Their Contribution to Enhancing Palatability. JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, [PMID:38959426] [10.1021/acs.jafc.4c02871] |
| 2. Siyang Yan, Ruilin Feng, Jiaxu Liu, Chenxi Bai, Yanlong Qi. (2024) Stereocatalytic Effect of CeO2 for the Synthesis of trans-3-Penten-2-ol. ChemCatChem, [PMID:] [10.1002/cctc.202401605] |
